SCHEMBL27420133

SCHEMBL27420133

CC(C)(C)OC(=O)NCc1ccc(OC(=O)Cl)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.51
L3MBTL1 Q9Y468 3/20 0.50
NAMPT P43490 2/20 0.48
HDAC1 Q13547 2/20 0.47
NPC1 O15118 2/20 0.47
RAB9A P51151 2/20 0.47
CA1 P00915 3/20 0.45
CA2 P00918 2/20 0.45
FAAH O00519 1/20 0.45
MAPT P10636 2/20 0.42
TDP1 Q9NUW8 1/20 0.42
HDAC10 Q969S8 1/20 0.42
HDAC6 Q9UBN7 1/20 0.42
RECQL P46063 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
KDM4A O75164 1/20 0.42
CA12 O43570 2/20 0.42
MEN1 O00255 1/20 0.42
EPHX2 P34913 1/20 0.42
KMT2A Q03164 1/20 0.42

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL7551243 0.87 L3MBTL1 (0.51) GAAL3MBTL1NAMPTHDAC1NPC1
SCHEMBL3180689 0.86 L3MBTL1 (0.61) GAAL3MBTL1NAMPTHDAC1CA1
SCHEMBL28619767 0.85 HDAC1 (0.50) GAAL3MBTL1NAMPTHDAC1NPC1
SCHEMBL16192930 0.85 GAA (0.61) GAAL3MBTL1NAMPTHDAC1TDP1
SCHEMBL8139001 0.84 L3MBTL1 (0.49) GAAL3MBTL1NAMPTHDAC1NPC1
SCHEMBL7652554 0.83 NPC1 (0.58) GAAL3MBTL1NAMPTHDAC1NPC1
SCHEMBL11957489 0.83 L3MBTL1 (0.53) GAAL3MBTL1NAMPTHDAC1NPC1
SCHEMBL17637647 0.83 L3MBTL1 (0.48) GAAL3MBTL1NAMPTHDAC1NPC1
SCHEMBL16192946 0.83 NPC1 (0.58) GAAL3MBTL1NAMPTHDAC1NPC1
SCHEMBL16192926 0.83 L3MBTL1 (0.48) GAAL3MBTL1NAMPTHDAC1NPC1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4637748-A2 PNU ANTHRACYCLINE-DERIVED LINKER-PAYLOADS, PHARMACEUTICAL COMPOSITIONS, AND USES THEREOF Merck Sharp & Dohme LLC (US) 2025-10-29 EP disclosed
WO-2024137502-A2 PNU ANTHRACYCLINE-DERIVED LINKER-PAYLOADS, PHARMACEUTICAL COMPOSITIONS, AND USES THEREOF MERCK SHARP & DOHME LLC (US) 2024-06-27 WO disclosed
WO-2024137502-A2 PNU ANTHRACYCLINE-DERIVED LINKER-PAYLOADS, PHARMACEUTICAL COMPOSITIONS, AND USES THEREOF MERCK SHARP & DOHME LLC (US) 2024-06-27 WO disclosed